acompound

Showing entry for stachydrine

　　　　　　　　　　　　　　　

General Compound Information
BXGC Id	BXGC0051652
Compound Name	stachydrine
Structure
Formula	C7H13NO2
InchiKey	CMUNUTVVOOHQPW-LURJTMIESA-O
SMILES	OC(=O)[C@@H]1CCC[N+]1(C)C
Inchi	InChI=1S/C7H13NO2/c1-8(2)5-3-4-6(8)7(9)10/h6H,3-5H2,1-2H3/p+1/t6-/m0/s1
IUPAC	(2S)-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid
Molecular Weight	144.1
Pubchem Id	448301
Chembl Id

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
P0AFM2	BXGT007353	Glycine betaine/proline betaine-binding periplasmic protein	reviewed	proX	-	-	-	-	-
O29280	BXGT004333	Osmoprotection protein (ProX)	unreviewed	AF_0982	-	-	-	50	-
P46922	BXGT010550	Glycine betaine-binding protein OpuAC	reviewed	opuAC	-	-	-	-	-
A1B198	BXGT000986	4-hydroxyproline betaine 2-epimerase	reviewed	hpbD	-	-	-	-	-
Q92SH9	BXGT023869	Probable chemoreceptor (Methyl-accepting chemotaxis) transmembrane protein	unreviewed	mcpX	-	-	-	-	-

Binding DB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM

CHEMBL

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00039	Capers	Capparis spinosa	Herbs and Spices
BXGF00264	Alfalfa	Medicago sativa	Herbs and Spices
BXGF01016	Glycyrrhiza squamulosa	Glycyrrhiza squamulosa	Medicinal Plant
BXGF02668	Stachys tuberifera	Stachys tuberifera	Medicinal Plant
BXGF03078	Chrysanthemum x morifolium	Chrysanthemum x morifolium	Medicinal Plant
BXGF03671	Leonurus japonicus	Leonurus japonicus	Medicinal Plant
BXGF04125	Leonurus sibiricus	Leonurus sibiricus	Medicinal Plant

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}